Geometry & MOs

Info

ID:	208848
PubChem CID:	80593717
Reduced:	ON2S2C11H20 (1)
Stoich.:	AB2C2D11E20 (1)
Weight, g/mol:	272.101706
ΔH_f, kcal/mol:	-68.66
Dipole, Da:	3.12
IP(EA), eV:	-8.61(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-carbamothioylcyclopentyl)thiane-2-carboxamide

Drug info:

PubChemData

Smile

CCC(CC(=S)N)NC(=O)C1CCCCS1

DOS

IR

Vibrations